3-methoxy-N-[[5-[4-[(3-methylsulfanylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide

Systemtic Name: 3-methoxy-N-[[5-[4-[(3-methylsulfanylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Openeye Name: 3-methoxy-N-[[5-[[4-(3-methylsulfanylanilino)-1-piperidyl]sulfonyl]-2-thienyl]methyl]benzamide CAS Name: 3-methoxy-N-[[5-[[4-[3-(methylthio)anilino]-1-piperidinyl]sulfonyl]-2-thiophenyl]methyl]benzamide IUPAC Name: 3-methoxy-N-[[5-[4-(3-methylsulfanylanilino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 3-methoxy-N-[[5-[4-[3-(methylthio)anilino]piperidino]sulfonyl-2-thienyl]methyl]benzamide Formula: C25H29N3O4S3 MolecularWeight: 531.71046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCC(CC3)NC4=CC(=CC=C4)SC

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCC(CC3)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C25H29N3O4S3/c1-32-21-7-3-5-18(15-21)25(29)26-17-23-9-10-24(34-23)35(30,31)28-13-11-19(12-14-28)27-20-6-4-8-22(16-20)33-2/h3-10,15-16,19,27H,11-14,17H2,1-2H3,(H,26,29)